Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 4/20 | 0.36 |
| ▸ | IDH1 | O75874 | 3/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 8/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1318487 | 1.00 | AURKA (0.42) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1317566 | 0.92 | AURKA (0.39) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1317719 | 0.92 | AURKA (0.39) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1317622 | 0.90 | AURKA (0.37) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1318131 | 0.87 | MTOR (0.45) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1319013 | 0.86 | PDPK1 (0.57) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1319290 | 0.85 | PDPK1 (0.42) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1317859 | 0.81 | MTOR (0.42) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1318381 | 0.80 | MTOR (0.43) | AURKAPDPK1ROCK1AURKBMTOR | |
| SCHEMBL1318732 | 0.79 | PDPK1 (0.51) | AURKAPDPK1ROCK1AURKBMTOR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2362775-A1 | CHEMICAL COMPOUNDS | GlaxoSmithKline LLC (US) | 2011-09-07 | — | — | EP | disclosed |
| WO-2010059658-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-05-27 | — | — | WO | disclosed |